A1D8V
Summary
| Name: | 5-[[(2~{S})-azetidin-2-yl]methoxy]-2-chloranyl-pyridine |
| Formula: | C9 H11 Cl N2 O |
| Formal charge: | 0 |
| Formula weight: | 198.649 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 5-[[(2~{S})-azetidin-2-yl]methoxy]-2-chloranyl-pyridine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C9H11ClN2O/c10-9-2-1-8(5-12-9)13-6-7-3-4-11-7/h1-2,5,7,11H,3-4,6H2/t7-/m0/s1 |
| InChIKey | InChI | 1.06 | MKTAGSRKQIGEBH-ZETCQYMHSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Clc1ccc(OC[C@@H]2CCN2)cn1 |
| SMILES | CACTVS | 3.385 | Clc1ccc(OC[CH]2CCN2)cn1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(ncc1OC[C@@H]2CCN2)Cl |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(ncc1OCC2CCN2)Cl |
